KEGG   DRUG: Isepamicin sulfate
Entry
D01826                      Drug                                   

Name
Isepamicin sulfate (JP17);
Isepacin (TN)
Formula
C22H43N5O12. xH2SO4
Structure
Simcomp
Class
Antibacterial
 DG01447  Aminoglycoside antibiotic
Remark
Therapeutic category: 6123
ATC code: J01GB11
Chemical structure group: DG00613
Product (DG00613): D01826<JP>
Efficacy
Antibacterial, Protein biosynthesis inhibitor
Target
30S ribosomal subunit
  Pathway
ko03010  Ribosome
Interaction
Structure map
map07021  Aminoglycosides
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01G AMINOGLYCOSIDE ANTIBACTERIALS
    J01GB Other aminoglycosides
     J01GB11 Isepamicin
      D01826  Isepamicin sulfate (JP17) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
 6  Agents against pathologic organisms and parasites
  61  Antibiotics
   612  Acting mainly on gram-negative bacteria
    6123  Amino sugars
     D01826  Isepamicin sulfate (JP17)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01826  Isepamicin sulfate
  D01826  Isepamicin sulfate injection
Other DBs
CAS: 67814-76-0
PubChem: 7848888
ChEBI: 31722
ChEMBL: CHEMBL3185832
LigandBox: D01826
NIKKAJI: J245.543I
LinkDB
KCF data

ATOM        44
            1   S4a S    39.5251  -14.9690
            2   O1d O    40.9206  -14.9690
            3   O1d O    38.1296  -14.9621
            4   O1d O    39.5180  -16.3644
            5   O1d O    39.5180  -13.5735
            6   C1y C    33.2500  -13.0900
            7   C1y C    33.2500  -11.6900
            8   C1y C    32.0600  -10.9900
            9   C1y C    30.8000  -11.6900
            10  C1y C    30.8000  -13.0900
            11  O2x O    32.0600  -13.7900
            12  O2a O    29.6100  -13.7900
            13  C1y C    29.6100  -15.1900
            14  C1y C    28.3500  -15.8900
            15  C1y C    28.3500  -17.2900
            16  C1y C    29.6100  -17.9900
            17  C1x C    30.8000  -17.2900
            18  C1y C    30.8000  -15.8900
            19  O2a O    27.0900  -17.9900
            20  C1b C    34.4400  -13.7900
            21  O1a O    29.6100  -10.9900
            22  N1a N    32.0600  -15.1900
            23  N1b N    29.6100  -19.3900
            24  O1a O    27.0900  -15.1900
            25  N1a N    34.4400  -15.1900
            26  C1y C    25.8300  -17.4300
            27  O2x O    25.8300  -16.0300
            28  C1x C    24.5000  -15.3300
            29  C1z C    23.3800  -16.1000
            30  C1y C    23.3800  -17.5000
            31  C1y C    24.6400  -18.1300
            32  O1a O    24.7100  -19.5300
            33  O1a O    22.2600  -15.4000
            34  N1b N    22.1900  -18.2000
            35  C1a C    21.0000  -17.6400
            36  O1a O    34.4400  -10.9900
            37  O1a O    32.0600   -9.5900
            38  C5a C    30.8000  -20.0900
            39  C1c C    31.9900  -19.3900
            40  C1b C    33.2500  -20.0900
            41  N1a N    34.4400  -19.3900
            42  O5a O    30.8000  -21.4900
            43  O1a O    31.9900  -17.9900
            44  C1a C    23.3800  -14.4900
BOND        45
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     1   5 2
            5    13  14 1
            6    14  15 1
            7    15  16 1
            8    26  27 1
            9    27  28 1
            10   28  29 1
            11   29  30 1
            12   30  31 1
            13   31  26 1
            14   16  17 1
            15   31  32 1 #Down
            16   17  18 1
            17   18  13 1
            18   29  33 1 #Up
            19   11   6 1
            20   30  34 1 #Up
            21   15  19 1 #Down
            22   34  35 1
            23    6  20 1 #Up
            24   10  12 1 #Down
            25    9  21 1 #Down
            26   18  22 1 #Up
            27   13  12 1 #Down
            28    7  36 1 #Down
            29   16  23 1 #Up
            30    8  37 1 #Up
            31    6   7 1
            32   14  24 1 #Up
            33    7   8 1
            34   20  25 1
            35    8   9 1
            36   26  19 1 #Down
            37    9  10 1
            38   10  11 1
            39   23  38 1
            40   38  39 1
            41   39  40 1
            42   40  41 1
            43   38  42 2
            44   39  43 1 #Up
            45   29  44 1 #Down
BRACKET     1    36.6800  -17.3600   36.6800  -12.6000
            1    42.1400  -12.6000   42.1400  -17.3600
            1  x
 ORIGINAL  1    1   2   3   4   5
 REPEAT    1

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